CID 5462960

Sodium n-nitro-1h-tetrazol-5-amide

Structural Information

Molecular Formula

SMILES

C1(=NNN=N1)N[N+](=O)[O-]

InChI

InChI=1S/CH2N6O2/c8-7(9)4-1-2-5-6-3-1/h(H2,2,3,4,5,6)

InChIKey

HURPOIVZCDCEEE-UHFFFAOYSA-N

Compound name

N-(2H-tetrazol-5-yl)nitramide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 391
Patents: 130.02393 Da
Monoisotopic Mass: 0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	131.03121	116.6
[M+Na]+	153.01315	124.7
[M-H]-	129.01665	114.5
[M+NH4]+	148.05775	132.9
[M+K]+	168.98709	119.9
[M+H-H2O]+	113.02119	112.9
[M+HCOO]-	175.02213	140.0
[M+CH3COO]-	189.03778	162.0
[M+Na-2H]-	150.99860	128.7
[M]+	130.02338	112.1
[M]-	130.02448	112.1

Literature stripe

literature stripe

Patent stripe

patents stripe